2-p-Tolyl-4H-isoquinoline-1,3-dione

Base Information

Chemical Name:2-p-Tolyl-4H-isoquinoline-1,3-dione
CAS No.:73109-31-6
Molecular Formula:C16H13 N O2
Molecular Weight:251.285
Hs Code.:2933499090
DSSTox Substance ID:DTXSID40395765
Nikkaji Number:J1.613.933E
Wikidata:Q82196037
ChEMBL ID:CHEMBL1430995
Mol file:73109-31-6.mol

Synonyms:2-p-Tolyl-4H-isoquinoline-1,3-dione;73109-31-6;2-(4-methylphenyl)-4H-isoquinoline-1,3-dione;2-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinoline-1,3-dione;2-(p-Tolyl)isoquinoline-1,3(2H,4H)-dione;2-(4-methylphenyl)isoquinoline-1,3(2H,4H)-dione;Oprea1_441684;CHEMBL1430995;SCHEMBL11867038;DTXSID40395765;HMS2903C09;STK823103;AKOS005178671;CCG-276440;2-p-Tolylisoquinoline-1,3(2H,4H)-dione;2-p-tolylisoquinoline-1,3 (2h,4h)-dione;CS-0218612;EN300-01492;2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione;Z56891289

Suppliers and Price of 2-p-Tolyl-4H-isoquinoline-1,3-dione

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
2-P-TOLYL-4H-ISOQUINOLINE-1,3-DIONE 95.00%
5G
$ 1005.43

American Custom Chemicals Corporation
2-P-TOLYL-4H-ISOQUINOLINE-1,3-DIONE 95.00%
2.5G
$ 852.21

American Custom Chemicals Corporation
2-P-TOLYL-4H-ISOQUINOLINE-1,3-DIONE 95.00%
1G
$ 648.81

AK Scientific
2-p-Tolyl-4H-isoquinoline-1,3-dione
1g
$ 387.00

AK Scientific
2-p-Tolyl-4H-isoquinoline-1,3-dione
250mg
$ 203.00

Total 5 raw suppliers

Chemical Property of 2-p-Tolyl-4H-isoquinoline-1,3-dione

Chemical Property:

Vapor Pressure:1.25E-08mmHg at 25°C
Melting Point:180 °C
Boiling Point:459.6°C at 760 mmHg
PKA:-0.06±0.20(Predicted)
Flash Point:219.3°C
PSA：37.38000
Density:1.251g/cm³
LogP:2.78950
XLogP3:2.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:251.094628657
Heavy Atom Count:19
Complexity:371

Purity/Quality:

98%Min ^*data from raw suppliers

2-P-TOLYL-4H-ISOQUINOLINE-1,3-DIONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)N2C(=O)CC3=CC=CC=C3C2=O

Technology Process of 2-p-Tolyl-4H-isoquinoline-1,3-dione

There total 4 articles about 2-p-Tolyl-4H-isoquinoline-1,3-dione which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 80.0%

: 106-49-0,12221-03-3
p-toluidine

: 703-59-3
homophthalic anhydride

: 73109-31-6
2-(4-methylphenyl)-1,3(2H,4H)-dioxoisoquinoline

Guidance literature:: In 1,2-dichloro-benzene; at 150 ℃; for 0.25h; Microwave irradiation;
DOI:10.1002/jhet.1105

Reference yield: 75.0%

: 89-51-0
Homophthalic acid

: 106-49-0,12221-03-3
p-toluidine

: 73109-31-6
2-(4-methylphenyl)-1,3(2H,4H)-dioxoisoquinoline

Guidance literature:: With zinc(II) oxide; In toluene; for 12h; Reflux;
DOI:10.1007/s11164-012-0511-3

Reference yield:

: 95-13-6
1-indene

: 73109-31-6
2-(4-methylphenyl)-1,3(2H,4H)-dioxoisoquinoline

Guidance literature:: Multi-step reaction with 2 steps

1: potassium dichromate; aqueous sulfuric acid

With potassium dichromate; sulfuric acid;